Dicirenone
CAS Registry Number®
41020-79-5
CAS Name
DicirenoneMolecular Formula
C26H36O5Molecular Mass
428.56Cite this Page
Dicirenone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=41020-79-5 (retrieved ) (CAS RN: 41020-79-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C26H36O5/c1-15(2)30-23(29)18-14-16-13-17(27)5-9-24(16,3)19-6-10-25(4)20(22(18)19)7-11-26(25)12-8-21(28)31-26/h13,15,18-20,22H,5-12,14H2,1-4H3/t18-,19+,20+,22-,24+,25+,26-/m1/s1
InChIKey
InChIKey=WUVPAYPBMZMHJO-IMNLCBETSA-N
SMILES
C[C@@]12[C@]3(CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(C[C@H]4C(OC(C)C)=O)=CC(=O)CC5)[H])[H])[H])OC(=O)CC3
Canonical SMILES
O=C1OC2(CC1)CCC3C4C(C(=O)OC(C)C)CC5=CC(=O)CCC5(C)C4CCC32C
Other Names for this Substance
- Pregn-4-ene-7,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, 1-methylethyl ester, (7α,17α)-
- SC 26304
- Dicirenone
Deleted or Replaced CAS Registry Numbers
52108-88-0